SpectraBase Spectrum ID |
EnULZEH9LvJ |
Name |
1-(4-Amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-chlorophenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
451.127198554 u |
Formula |
C20H18ClN9O2 |
InChI |
InChI=1S/C20H18ClN9O2/c1-29(15-8-3-2-4-9-15)12-16-17(24-28-30(16)19-18(22)26-32-27-19)20(31)25-23-11-13-6-5-7-14(21)10-13/h2-11H,12H2,1H3,(H2,22,26)(H,25,31)/b23-11+ |
InChIKey |
AXMLMPIILLUKMZ-FOKLQQMPSA-N |
Molecular Weight |
451.878 g/mol |
SMILES |
NC=1C(N2C(=C(C(N\N=C\C3=CC(Cl)=CC=C3)=O)N=N2)CN(C2=CC=CC=C2)C)=NON1 |